3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile

Systemtic Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-morpholin-4-ylcarbonyl-prop-2-enenitrile Openeye Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile CAS Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-[4-morpholinyl(oxo)methyl]-2-propenenitrile IUPAC Name: 3-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-(morpholine-4-carbonyl)prop-2-enenitrile Traditional Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-(morpholine-4-carbonyl)acrylonitrile Formula: C20H20BrN3O2 MolecularWeight: 414.2957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C(C#N)C(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C(C#N)C(=O)N3CCOCC3

InChI

InChI=1S/C20H20BrN3O2/c1-14-11-16(15(2)24(14)19-5-3-18(21)4-6-19)12-17(13-22)20(25)23-7-9-26-10-8-23/h3-6,11-12H,7-10H2,1-2H3